Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | RARB | P10826 | 7/20 | 0.40 |
| ▸ | RARA | P10276 | 2/20 | 0.40 |
| ▸ | RARG | P13631 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9766638 | 0.99 | HSD17B10 (0.48) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9155712 | 0.96 | TSHR (0.43) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9158620 | 0.96 | HSD17B10 (0.42) | HSD17B10TSHRALDH1A1KDM4EFFAR1 | |
| SCHEMBL9157598 | 0.95 | HSD17B10 (0.44) | HSD17B10TSHRALDH1A1KDM4EFFAR1 | |
| SCHEMBL9153691 | 0.92 | FFAR1 (0.39) | HSD17B10TSHRALDH1A1RAB9AHPGD | |
| SCHEMBL9158563 | 0.91 | FFAR1 (0.38) | HSD17B10TSHRMAPTRAB9AFFAR1 | |
| SCHEMBL9766633 | 0.88 | HSD17B10 (0.39) | HSD17B10TSHRALDH1A1KDM4EFFAR1 | |
| SCHEMBL9874595 | 0.87 | HSD17B10 (0.39) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9766643 | 0.87 | FFAR1 (0.36) | HSD17B10TSHRFFAR1CHRM2 | |
| SCHEMBL9158273 | 0.86 | FFAR1 (0.40) | FFAR1CHRM2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0445248-B1 | PYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 1995-03-08 | — | — | EP | disclosed |
| US-5205962-A | Stable liquid crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-04-27 | — | — | US | disclosed |
| WO-1991004248-A1 | PYRIDINE DERIVATIVES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-04-04 | — | — | WO | disclosed |